2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[2-(trifluoromethyl)-1H-indol-3-yl]propanoic acid

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[2-(trifluoromethyl)-1H-indol-3-yl]propanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-3-[2-(trifluoromethyl)-1H-indol-3-yl]propanoic acid CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[2-(trifluoromethyl)-1H-indol-3-yl]propanoic acid IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[2-(trifluoromethyl)-1H-indol-3-yl]propanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-3-[2-(trifluoromethyl)-1H-indol-3-yl]propionic acid Formula: C17H19F3N2O4 MolecularWeight: 372.33897

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=C(NC2=CC=CC=C21)C(F)(F)F)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=C(NC2=CC=CC=C21)C(F)(F)F)C(=O)O

InChI

InChI=1S/C17H19F3N2O4/c1-16(2,3)26-15(25)22-12(14(23)24)8-10-9-6-4-5-7-11(9)21-13(10)17(18,19)20/h4-7,12,21H,8H2,1-3H3,(H,22,25)(H,23,24)